ANALYTICONDISCOVERY-ZINC04222091 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 80 0 0 1 0 0 0 0 0999 V2000 3.0080 0.9610 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -0.4590 -0.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9300 -1.1750 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 -0.6010 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -1.2370 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3620 -1.1880 -0.5010 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 -0.3170 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -0.1210 0.9070 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 0.1160 1.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1090 -0.1440 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5270 -0.7570 0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0620 0.3260 2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7510 -0.1760 2.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8880 -1.5880 2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2060 0.5410 1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7440 0.4340 3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9790 -0.3560 4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7580 0.1220 5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3010 1.3910 5.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0670 2.1810 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2920 1.7010 3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -1.8760 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -2.0480 -2.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0140 -0.7310 -1.7030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3570 0.0840 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -0.8270 -1.7370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1570 -1.6040 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -1.1670 -3.1460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0840 -1.2220 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -2.5220 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -2.4120 -3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -0.0870 -4.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5540 0.0320 -4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 1.2390 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -0.4920 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -1.2460 -5.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -0.0170 -6.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -0.3420 -7.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 0.9390 -8.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 2.1180 -8.6340 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 2.2290 -6.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 0.8220 -6.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 0.4260 -1.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -3.1590 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 1.6630 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 1.0150 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 1.2170 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 0.6060 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0140 1.4120 2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7850 -0.1190 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5540 -1.3480 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9410 -0.4950 6.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9090 1.7650 6.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4910 3.1730 4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1110 2.3170 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3910 -1.2410 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 -2.8520 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -3.2830 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.7900 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -1.6410 -4.2760 H 0 0 0 0 0 0 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